[(1S)-2-azanyl-2-oxidanylidene-1-phenyl-ethyl] 4-(2,5-dimethylthiophen-3-yl)-4-oxidanylidene-butanoate

Systemtic Name: [(1S)-2-azanyl-2-oxidanylidene-1-phenyl-ethyl] 4-(2,5-dimethylthiophen-3-yl)-4-oxidanylidene-butanoate Openeye Name: [(1S)-2-amino-2-oxo-1-phenyl-ethyl] 4-(2,5-dimethyl-3-thienyl)-4-oxo-butanoate CAS Name: 4-(2,5-dimethyl-3-thiophenyl)-4-oxobutanoic acid [(1S)-2-amino-2-oxo-1-phenylethyl] ester IUPAC Name: [(1S)-2-amino-2-oxo-1-phenylethyl] 4-(2,5-dimethylthiophen-3-yl)-4-oxobutanoate Traditional Name: 4-(2,5-dimethyl-3-thienyl)-4-keto-butyric acid [(1S)-2-amino-2-keto-1-phenyl-ethyl] ester Formula: C18H19NO4S MolecularWeight: 345.41276

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(S1)C)C(=O)CCC(=O)OC(C2=CC=CC=C2)C(=O)N

Isomeric SMILES

CC1=CC(=C(S1)C)C(=O)CCC(=O)O[C@@H](C2=CC=CC=C2)C(=O)N

InChI

InChI=1S/C18H19NO4S/c1-11-10-14(12(2)24-11)15(20)8-9-16(21)23-17(18(19)22)13-6-4-3-5-7-13/h3-7,10,17H,8-9H2,1-2H3,(H2,19,22)/t17-/m0/s1